[(2R,3S,5R)-2-(hydroxymethyl)-5-[5-methyl-2,4-bis(oxidanylidene)-1,3-diazinan-1-yl]oxolan-3-yl] (4-nitrophenyl) hydrogen phosphate

Systemtic Name: [(2R,3S,5R)-2-(hydroxymethyl)-5-[5-methyl-2,4-bis(oxidanylidene)-1,3-diazinan-1-yl]oxolan-3-yl] (4-nitrophenyl) hydrogen phosphate Openeye Name: [(2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-hexahydropyrimidin-1-yl)tetrahydrofuran-3-yl] (4-nitrophenyl) hydrogen phosphate CAS Name: [(2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-1,3-diazinan-1-yl)-3-oxolanyl] (4-nitrophenyl) hydrogen phosphate IUPAC Name: [(2R,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-1,3-diazinan-1-yl)oxolan-3-yl] (4-nitrophenyl) hydrogen phosphate Traditional Name: [(2R,3S,5R)-5-(2,4-diketo-5-methyl-hexahydropyrimidin-1-yl)-2-methylol-tetrahydrofuran-3-yl] (4-nitrophenyl) hydrogen phosphate Formula: C16H20N3O10P MolecularWeight: 445.317861

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(=O)NC1=O)C2CC(C(O2)CO)OP(=O)(O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)OP(=O)(O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H20N3O10P/c1-9-7-18(16(22)17-15(9)21)14-6-12(13(8-20)27-14)29-30(25,26)28-11-4-2-10(3-5-11)19(23)24/h2-5,9,12-14,20H,6-8H2,1H3,(H,25,26)(H,17,21,22)/t9?,12-,13+,14+/m0/s1